2,6-dimethylcyclohexa-1,5-dien-1-ol

C8H12O — CID 14982407

IUPAC2,6-dimethylcyclohexa-1,5-dien-1-ol
SMILESCC1=CCCC(C)=C1O
InChIInChI=1S/C8H12O/c1-6-4-3-5-7(2)8(6)9/h4,9H,3,5H2,1-2H3
InChIKeyOPDYDMMIJFNDPY-UHFFFAOYSA-N
MW124.18 g/mol
LogP2.56
Rot. Bonds

About 2,6-dimethylcyclohexa-1,5-dien-1-ol

2,6-dimethylcyclohexa-1,5-dien-1-ol (PubChem CID 14982407) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is 2,6-dimethylcyclohexa-1,5-dien-1-ol.

Molecular Properties

Compound Name2,6-dimethylcyclohexa-1,5-dien-1-ol
PubChem CID14982407
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name2,6-dimethylcyclohexa-1,5-dien-1-ol
SMILESCC1=CCCC(C)=C1O
InChIInChI=1S/C8H12O/c1-6-4-3-5-7(2)8(6)9/h4,9H,3,5H2,1-2H3
InChIKeyOPDYDMMIJFNDPY-UHFFFAOYSA-N
XLogP2.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylcyclohexa-1,5-dien-1-ol?
The IUPAC name of 2,6-dimethylcyclohexa-1,5-dien-1-ol (CID 14982407) is 2,6-dimethylcyclohexa-1,5-dien-1-ol.
What is the SMILES notation for 2,6-dimethylcyclohexa-1,5-dien-1-ol?
The canonical SMILES for 2,6-dimethylcyclohexa-1,5-dien-1-ol is CC1=CCCC(C)=C1O.
What is the InChIKey of 2,6-dimethylcyclohexa-1,5-dien-1-ol?
The InChIKey is OPDYDMMIJFNDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O/c1-6-4-3-5-7(2)8(6)9/h4,9H,3,5H2,1-2H3.
What are the key properties of 2,6-dimethylcyclohexa-1,5-dien-1-ol?
2,6-dimethylcyclohexa-1,5-dien-1-ol has a molecular weight of 124.18 g/mol, XLogP of 2.56, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylcyclohexa-1,5-dien-1-ol is sourced from PubChem (CID 14982407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).